3,10-diphenyl-7-(5-phenylpyrazin-2-yl)pyrrolo[3,2-a]carbazole

C36H24N4 — CID 123618530

IUPAC3,10-diphenyl-7-(5-phenylpyrazin-2-yl)pyrrolo[3,2-a]carbazole
SMILESc1ccc(-c2cnc(-c3ccc4c(c3)c3ccc5c(ccn5-c5ccccc5)c3n4-c3ccccc3)cn2)cc1
InChIInChI=1S/C36H24N4/c1-4-10-25(11-5-1)32-23-38-33(24-37-32)26-16-18-35-31(22-26)29-17-19-34-30(20-21-39(34)27-12-6-2-7-13-27)36(29)40(35)28-14-8-3-9-15-28/h1-24H
InChIKeyUZUMMMNFRHGLTM-UHFFFAOYSA-N
MW512.62 g/mol
LogP8.85
Rot. Bonds4

About 3,10-diphenyl-7-(5-phenylpyrazin-2-yl)pyrrolo[3,2-a]carbazole

3,10-diphenyl-7-(5-phenylpyrazin-2-yl)pyrrolo[3,2-a]carbazole (PubChem CID 123618530) has the molecular formula C36H24N4 and a molecular weight of 512.62 g/mol. Its IUPAC name is 3,10-diphenyl-7-(5-phenylpyrazin-2-yl)pyrrolo[3,2-a]carbazole.

Molecular Properties

Compound Name3,10-diphenyl-7-(5-phenylpyrazin-2-yl)pyrrolo[3,2-a]carbazole
PubChem CID123618530
Molecular FormulaC36H24N4
Molecular Weight512.62 g/mol
Exact Mass512.20
IUPAC Name3,10-diphenyl-7-(5-phenylpyrazin-2-yl)pyrrolo[3,2-a]carbazole
SMILESc1ccc(-c2cnc(-c3ccc4c(c3)c3ccc5c(ccn5-c5ccccc5)c3n4-c3ccccc3)cn2)cc1
InChIInChI=1S/C36H24N4/c1-4-10-25(11-5-1)32-23-38-33(24-37-32)26-16-18-35-31(22-26)29-17-19-34-30(20-21-39(34)27-12-6-2-7-13-27)36(29)40(35)28-14-8-3-9-15-28/h1-24H
InChIKeyUZUMMMNFRHGLTM-UHFFFAOYSA-N
XLogP8.85
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500512.62
LogP ≤ 58.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

10-(3,5-diphenylphenyl)-3-phenyl-7-(4-pyridin-2-ylphenyl)pyrrolo[3,2-a]carbazole
CID 123851568
3-phenyl-10-[4-(7-phenyltriphenylen-2-yl)phenyl]pyrrolo[3,2-a]carbazole
CID 118314952
3-phenyl-10-(3-triphenylen-2-ylphenyl)pyrrolo[3,2-a]carbazole
CID 118314949
23-(4,6-diphenylpyrimidin-2-yl)-10,18-diphenyl-10,18,23-triazahexacyclo[11.10.0.03,11.04,9.014,22.017,21]tricosa-1(13),2,4,6,8,11,14(22),15,17(21),19-decaene
CID 90267453
10,19-diphenyl-14-(5-phenyl-2-pyridinyl)-10,14,19-triazahexacyclo[11.10.0.03,11.04,9.015,23.016,20]tricosa-1(13),2,4,6,8,11,15(23),16(20),17,21-decaene
CID 90267349
14-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-10,19-diphenyl-10,14,19-triazahexacyclo[11.10.0.03,11.04,9.015,23.016,20]tricosa-1(13),2,4,6,8,11,15(23),16(20),17,21-decaene
CID 90267426
10-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenylphenyl]-3-phenyl-7-(9-phenylcarbazol-3-yl)pyrrolo[3,2-a]carbazole
CID 90183196
10-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-(3,5-diphenylphenyl)pyrrolo[3,2-a]carbazole
CID 118315552
4-[3-(3,7-diphenylpyrrolo[3,2-a]carbazol-10-yl)phenyl]benzonitrile
CID 118260329
3,10-diphenyl-7-[4-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]phenyl]pyrrolo[3,2-a]carbazole
CID 118317666
7-(2-nitrophenyl)-3,10-diphenylpyrrolo[3,2-a]carbazole
CID 90257402
14-[4-(3,5-diphenyl-1,2,4-triazol-4-yl)phenyl]-10,19-diphenyl-10,14,19-triazahexacyclo[11.10.0.03,11.04,9.015,23.016,20]tricosa-1(13),2,4,6,8,11,15(23),16(20),17,21-decaene
CID 90267242

Frequently Asked Questions

What is the IUPAC name of 3,10-diphenyl-7-(5-phenylpyrazin-2-yl)pyrrolo[3,2-a]carbazole?
The IUPAC name of 3,10-diphenyl-7-(5-phenylpyrazin-2-yl)pyrrolo[3,2-a]carbazole (CID 123618530) is 3,10-diphenyl-7-(5-phenylpyrazin-2-yl)pyrrolo[3,2-a]carbazole.
What is the SMILES notation for 3,10-diphenyl-7-(5-phenylpyrazin-2-yl)pyrrolo[3,2-a]carbazole?
The canonical SMILES for 3,10-diphenyl-7-(5-phenylpyrazin-2-yl)pyrrolo[3,2-a]carbazole is c1ccc(-c2cnc(-c3ccc4c(c3)c3ccc5c(ccn5-c5ccccc5)c3n4-c3ccccc3)cn2)cc1.
What is the InChIKey of 3,10-diphenyl-7-(5-phenylpyrazin-2-yl)pyrrolo[3,2-a]carbazole?
The InChIKey is UZUMMMNFRHGLTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H24N4/c1-4-10-25(11-5-1)32-23-38-33(24-37-32)26-16-18-35-31(22-26)29-17-19-34-30(20-21-39(34)27-12-6-2-7-13-27)36(29)40(35)28-14-8-3-9-15-28/h1-24H.
What are the key properties of 3,10-diphenyl-7-(5-phenylpyrazin-2-yl)pyrrolo[3,2-a]carbazole?
3,10-diphenyl-7-(5-phenylpyrazin-2-yl)pyrrolo[3,2-a]carbazole has a molecular weight of 512.62 g/mol, XLogP of 8.85, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,10-diphenyl-7-(5-phenylpyrazin-2-yl)pyrrolo[3,2-a]carbazole is sourced from PubChem (CID 123618530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).